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Incorporate packing code into repository #27

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malramsay64 opened this issue Dec 11, 2018 · 2 comments
Closed

Incorporate packing code into repository #27

malramsay64 opened this issue Dec 11, 2018 · 2 comments
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enhancement New feature or request

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@malramsay64
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The packing code https://github.com/malramsay64/2d-packing will allow for finding a range of crystal structures for different shapes of molecules.

This will likely be thorough a CLI outputting a useful format which can then be read into creating a crystal lattice.

Trimer model see: malramsay64/2d-packing#5
Output parameters: malramsay64/2d-packing#6

@malramsay64 malramsay64 added the enhancement New feature or request label Dec 11, 2018
@malramsay64
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The packing code has now been rewritten in rust and is available at https://github.com/malramsay64/packing

@malramsay64
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This will now involve creating a conda package for the packing code which can then be added as one of the dependencies of this project.

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